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Sulfabromomethazine structure
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Sulfabromomethazine

TL;DR: Sulfabromomethazine (CAS 116-45-0) is a chemical compound with molecular formula C12H13BrN4O2S and molecular weight 355.99426 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-amino-N-(5-bromo-4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Also Known As: Sulfabrom, SULFABROMOMETHAZINE, Bromosulfamethazine, 5-Bromosulfamethazine, Sulfabromomethazine sodium

CAS Number
116-45-0
Molecular Formula
C12H13BrN4O2S
Molecular Weight
355.99426 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Food Additives (3 patents) Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (21 patents)

Technical Specifications

Molecular FormulaC12H13BrN4O2S
Molecular Weight355.99426 g/mol
XLogP1.0
Topological Polar Surface Area (TPSA)106.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass355.99426 Da
Heavy Atoms20
Complexity408.0
SMILESCC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C)Br
InChIKeyKWXCNODTHBHSIQ-UHFFFAOYSA-N

Product Description

Applications: Sulfabromomethazine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A pharmaceutical intermediate supplied by CoreyChem, Sulfabromomethazine (CAS 116-45-0) has the molecular formula C12H13BrN4O2S and a molecular weight of 355.99 g/mol. Synonyms include Sulfabrom and SULFABROMOMETHAZINE.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Sulfabromomethazine

XLogP
1.0
TPSA (Topological Polar Surface Area)
106.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
20
Complexity
408.0
Exact Mass
355.99426
Monoisotopic Mass
355.99426
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Sulfabromomethazine

The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfabromomethazine. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfabromomethazine. Following Lipinski's Rule of Five, Sulfabromomethazine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Sulfabromomethazine?

The CAS number of Sulfabromomethazine is 116-45-0.

What is the molecular formula of Sulfabromomethazine?

The molecular formula of Sulfabromomethazine is C12H13BrN4O2S.

What is the molecular weight of Sulfabromomethazine?

The molecular weight of Sulfabromomethazine is 355.99426 g/mol.

What are the applications of Sulfabromomethazine?

Sulfabromomethazine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Sulfabromomethazine?

You can request a quote for Sulfabromomethazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Sulfabromomethazine?

Yes, CoreyChem provides custom synthesis services for Sulfabromomethazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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